UCSF

ZINC22042145

Annotations

Vendors

    None

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.14 8.53 -48.78 2 9 1 90 427.529 7
Mid Mid (pH 6-8) 1.14 8.58 -51.81 2 9 1 90 427.529 7
Mid Mid (pH 6-8) 1.14 6.26 -15.44 1 9 0 89 426.521 7

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )